Content for NMR-STAR saveframe, "assigned_chemical_shifts_1"
save_assigned_chemical_shifts_1
_Assigned_chem_shift_list.Sf_category assigned_chemical_shifts
_Assigned_chem_shift_list.Sf_framecode assigned_chemical_shifts_1
_Assigned_chem_shift_list.Entry_ID 50747
_Assigned_chem_shift_list.ID 1
_Assigned_chem_shift_list.Name 'Psb28-CP47 C-termianl complex'
_Assigned_chem_shift_list.Sample_condition_list_ID 1
_Assigned_chem_shift_list.Sample_condition_list_label $sample_conditions_1
_Assigned_chem_shift_list.Chem_shift_reference_ID 1
_Assigned_chem_shift_list.Chem_shift_reference_label $chem_shift_reference_1
_Assigned_chem_shift_list.Chem_shift_1H_err .
_Assigned_chem_shift_list.Chem_shift_13C_err .
_Assigned_chem_shift_list.Chem_shift_15N_err .
_Assigned_chem_shift_list.Chem_shift_31P_err .
_Assigned_chem_shift_list.Chem_shift_2H_err .
_Assigned_chem_shift_list.Chem_shift_19F_err .
_Assigned_chem_shift_list.Error_derivation_method .
_Assigned_chem_shift_list.Details .
_Assigned_chem_shift_list.Text_data_format .
_Assigned_chem_shift_list.Text_data .
loop_
_Chem_shift_experiment.Experiment_ID
_Chem_shift_experiment.Experiment_name
_Chem_shift_experiment.Sample_ID
_Chem_shift_experiment.Sample_label
_Chem_shift_experiment.Sample_state
_Chem_shift_experiment.Entry_ID
_Chem_shift_experiment.Assigned_chem_shift_list_ID
5 '1D 1H' . . . 50747 1
6 '2D 1H-15N HSQC' . . . 50747 1
7 '3D HN(CO)CACB' . . . 50747 1
8 '3D HNCA' . . . 50747 1
9 '3D HNCO' . . . 50747 1
10 '3D HNCACB' . . . 50747 1
11 '3D HN(CA)CO' . . . 50747 1
12 '3D H(CCO)NH' . . . 50747 1
13 '3D HNHA' . . . 50747 1
14 '3D 1H-15N NOESY' . . . 50747 1
stop_
loop_
_Chem_shift_software.Software_ID
_Chem_shift_software.Software_label
_Chem_shift_software.Method_ID
_Chem_shift_software.Method_label
_Chem_shift_software.Entry_ID
_Chem_shift_software.Assigned_chem_shift_list_ID
1 $software_1 . . 50747 1
stop_
loop_
_Atom_chem_shift.ID
_Atom_chem_shift.Assembly_atom_ID
_Atom_chem_shift.Entity_assembly_ID
_Atom_chem_shift.Entity_assembly_asym_ID
_Atom_chem_shift.Entity_ID
_Atom_chem_shift.Comp_index_ID
_Atom_chem_shift.Seq_ID
_Atom_chem_shift.Comp_ID
_Atom_chem_shift.Atom_ID
_Atom_chem_shift.Atom_type
_Atom_chem_shift.Atom_isotope_number
_Atom_chem_shift.Val
_Atom_chem_shift.Val_err
_Atom_chem_shift.Assign_fig_of_merit
_Atom_chem_shift.Ambiguity_code
_Atom_chem_shift.Ambiguity_set_ID
_Atom_chem_shift.Occupancy
_Atom_chem_shift.Resonance_ID
_Atom_chem_shift.Auth_entity_assembly_ID
_Atom_chem_shift.Auth_asym_ID
_Atom_chem_shift.Auth_seq_ID
_Atom_chem_shift.Auth_comp_ID
_Atom_chem_shift.Auth_atom_ID
_Atom_chem_shift.Details
_Atom_chem_shift.Entry_ID
_Atom_chem_shift.Assigned_chem_shift_list_ID
1 . 1 . 1 3 3 MET HA H 1 4.455 . . 1 . . 1664 . . 3 MET HA . 50747 1
2 . 1 . 1 3 3 MET C C 13 176.386 . . 1 . . 1584 . . 3 MET C . 50747 1
3 . 1 . 1 3 3 MET CA C 13 55.495 0.012 . 1 . . 1582 . . 3 MET CA . 50747 1
4 . 1 . 1 3 3 MET CB C 13 32.844 0.078 . 1 . . 1583 . . 3 MET CB . 50747 1
5 . 1 . 1 4 4 GLY H H 1 8.321 0.005 . 1 . . 1576 . . 4 GLY H . 50747 1
6 . 1 . 1 4 4 GLY HA2 H 1 3.900 . . 1 . . 1665 . . 4 GLY HA2 . 50747 1
7 . 1 . 1 4 4 GLY HA3 H 1 3.900 . . 1 . . 1666 . . 4 GLY HA3 . 50747 1
8 . 1 . 1 4 4 GLY C C 13 173.536 0.001 . 1 . . 1565 . . 4 GLY C . 50747 1
9 . 1 . 1 4 4 GLY CA C 13 45.294 0.041 . 1 . . 1581 . . 4 GLY CA . 50747 1
10 . 1 . 1 4 4 GLY N N 15 110.309 0.026 . 1 . . 1577 . . 4 GLY N . 50747 1
11 . 1 . 1 5 5 ALA H H 1 8.170 0.002 . 1 . . 1272 . . 5 ALA H . 50747 1
12 . 1 . 1 5 5 ALA HA H 1 4.352 . . 1 . . 1667 . . 5 ALA HA . 50747 1
13 . 1 . 1 5 5 ALA C C 13 177.255 0.004 . 1 . . 1490 . . 5 ALA C . 50747 1
14 . 1 . 1 5 5 ALA CA C 13 52.154 0.044 . 1 . . 1341 . . 5 ALA CA . 50747 1
15 . 1 . 1 5 5 ALA CB C 13 19.529 0.014 . 1 . . 1340 . . 5 ALA CB . 50747 1
16 . 1 . 1 5 5 ALA N N 15 123.850 0.014 . 1 . . 1273 . . 5 ALA N . 50747 1
17 . 1 . 1 6 6 MET H H 1 8.277 0.002 . 1 . . 1091 . . 6 MET H . 50747 1
18 . 1 . 1 6 6 MET HA H 1 4.412 0.003 . 1 . . 1652 . . 6 MET HA . 50747 1
19 . 1 . 1 6 6 MET C C 13 175.280 0.002 . 1 . . 1491 . . 6 MET C . 50747 1
20 . 1 . 1 6 6 MET CA C 13 55.870 0.009 . 1 . . 1338 . . 6 MET CA . 50747 1
21 . 1 . 1 6 6 MET CB C 13 33.526 0.013 . 1 . . 1339 . . 6 MET CB . 50747 1
22 . 1 . 1 6 6 MET N N 15 120.742 0.017 . 1 . . 1092 . . 6 MET N . 50747 1
23 . 1 . 1 7 7 ALA H H 1 8.366 0.001 . 1 . . 1129 . . 7 ALA H . 50747 1
24 . 1 . 1 7 7 ALA HA H 1 5.521 0.003 . 1 . . 1653 . . 7 ALA HA . 50747 1
25 . 1 . 1 7 7 ALA C C 13 175.959 0.004 . 1 . . 1506 . . 7 ALA C . 50747 1
26 . 1 . 1 7 7 ALA CA C 13 51.911 0.041 . 1 . . 1336 . . 7 ALA CA . 50747 1
27 . 1 . 1 7 7 ALA CB C 13 21.363 0.019 . 1 . . 1337 . . 7 ALA CB . 50747 1
28 . 1 . 1 7 7 ALA N N 15 126.297 0.028 . 1 . . 1130 . . 7 ALA N . 50747 1
29 . 1 . 1 8 8 GLU H H 1 9.170 0.002 . 1 . . 1167 . . 8 GLU H . 50747 1
30 . 1 . 1 8 8 GLU HA H 1 5.087 0.016 . 1 . . 1654 . . 8 GLU HA . 50747 1
31 . 1 . 1 8 8 GLU C C 13 173.962 0.006 . 1 . . 1526 . . 8 GLU C . 50747 1
32 . 1 . 1 8 8 GLU CA C 13 54.541 0.028 . 1 . . 1335 . . 8 GLU CA . 50747 1
33 . 1 . 1 8 8 GLU CB C 13 35.794 0.021 . 1 . . 1334 . . 8 GLU CB . 50747 1
34 . 1 . 1 8 8 GLU N N 15 119.504 0.036 . 1 . . 1168 . . 8 GLU N . 50747 1
35 . 1 . 1 9 9 ILE H H 1 9.500 0.003 . 1 . . 1270 . . 9 ILE H . 50747 1
36 . 1 . 1 9 9 ILE HA H 1 4.733 0.013 . 1 . . 1655 . . 9 ILE HA . 50747 1
37 . 1 . 1 9 9 ILE C C 13 174.443 0.003 . 1 . . 1488 . . 9 ILE C . 50747 1
38 . 1 . 1 9 9 ILE CA C 13 60.439 0.056 . 1 . . 1331 . . 9 ILE CA . 50747 1
39 . 1 . 1 9 9 ILE CB C 13 40.064 0.078 . 1 . . 1332 . . 9 ILE CB . 50747 1
40 . 1 . 1 9 9 ILE N N 15 121.200 0.03 . 1 . . 1271 . . 9 ILE N . 50747 1
41 . 1 . 1 10 10 GLN H H 1 9.015 0.002 . 1 . . 1081 . . 10 GLN H . 50747 1
42 . 1 . 1 10 10 GLN HA H 1 4.869 0.003 . 1 . . 1656 . . 10 GLN HA . 50747 1
43 . 1 . 1 10 10 GLN C C 13 174.883 0.012 . 1 . . 1489 . . 10 GLN C . 50747 1
44 . 1 . 1 10 10 GLN CA C 13 53.650 0.028 . 1 . . 1333 . . 10 GLN CA . 50747 1
45 . 1 . 1 10 10 GLN CB C 13 31.455 0.027 . 1 . . 1434 . . 10 GLN CB . 50747 1
46 . 1 . 1 10 10 GLN N N 15 123.550 0.044 . 1 . . 1082 . . 10 GLN N . 50747 1
47 . 1 . 1 11 11 PHE H H 1 10.000 0.003 . 1 . . 1195 . . 11 PHE H . 50747 1
48 . 1 . 1 11 11 PHE HA H 1 5.091 0.002 . 1 . . 1657 . . 11 PHE HA . 50747 1
49 . 1 . 1 11 11 PHE C C 13 175.433 0.015 . 1 . . 1566 . . 11 PHE C . 50747 1
50 . 1 . 1 11 11 PHE CA C 13 59.648 0.045 . 1 . . 1397 . . 11 PHE CA . 50747 1
51 . 1 . 1 11 11 PHE CB C 13 41.321 0.069 . 1 . . 1435 . . 11 PHE CB . 50747 1
52 . 1 . 1 11 11 PHE N N 15 121.763 0.029 . 1 . . 1196 . . 11 PHE N . 50747 1
53 . 1 . 1 12 12 ILE H H 1 7.957 0.002 . 1 . . 1233 . . 12 ILE H . 50747 1
54 . 1 . 1 12 12 ILE HA H 1 4.119 0.006 . 1 . . 1658 . . 12 ILE HA . 50747 1
55 . 1 . 1 12 12 ILE C C 13 175.717 0.003 . 1 . . 1509 . . 12 ILE C . 50747 1
56 . 1 . 1 12 12 ILE CA C 13 59.669 0.045 . 1 . . 1567 . . 12 ILE CA . 50747 1
57 . 1 . 1 12 12 ILE CB C 13 39.714 0.025 . 1 . . 1398 . . 12 ILE CB . 50747 1
58 . 1 . 1 12 12 ILE N N 15 121.364 0.048 . 1 . . 1234 . . 12 ILE N . 50747 1
59 . 1 . 1 13 13 ARG H H 1 8.413 0.001 . 1 . . 1133 . . 13 ARG H . 50747 1
60 . 1 . 1 13 13 ARG HA H 1 3.555 0.002 . 1 . . 1659 . . 13 ARG HA . 50747 1
61 . 1 . 1 13 13 ARG C C 13 177.479 0.003 . 1 . . 1510 . . 13 ARG C . 50747 1
62 . 1 . 1 13 13 ARG CA C 13 58.705 0.045 . 1 . . 1466 . . 13 ARG CA . 50747 1
63 . 1 . 1 13 13 ARG CB C 13 28.990 0.025 . 1 . . 1467 . . 13 ARG CB . 50747 1
64 . 1 . 1 13 13 ARG N N 15 125.951 0.026 . 1 . . 1134 . . 13 ARG N . 50747 1
65 . 1 . 1 14 14 GLY H H 1 8.031 0.001 . 1 . . 1258 . . 14 GLY H . 50747 1
66 . 1 . 1 14 14 GLY HA2 H 1 3.558 0.001 . 2 . . 1660 . . 14 GLY HA2 . 50747 1
67 . 1 . 1 14 14 GLY HA3 H 1 4.252 0.011 . 2 . . 1661 . . 14 GLY HA3 . 50747 1
68 . 1 . 1 14 14 GLY C C 13 173.813 0.009 . 1 . . 1564 . . 14 GLY C . 50747 1
69 . 1 . 1 14 14 GLY CA C 13 44.928 0.022 . 1 . . 1468 . . 14 GLY CA . 50747 1
70 . 1 . 1 14 14 GLY N N 15 112.301 0.03 . 1 . . 1259 . . 14 GLY N . 50747 1
71 . 1 . 1 15 15 ILE H H 1 8.353 0.002 . 1 . . 1179 . . 15 ILE H . 50747 1
72 . 1 . 1 15 15 ILE HA H 1 4.250 0.009 . 1 . . 1662 . . 15 ILE HA . 50747 1
73 . 1 . 1 15 15 ILE C C 13 175.753 0.004 . 1 . . 1481 . . 15 ILE C . 50747 1
74 . 1 . 1 15 15 ILE CA C 13 59.831 0.046 . 1 . . 1307 . . 15 ILE CA . 50747 1
75 . 1 . 1 15 15 ILE CB C 13 38.268 0.013 . 1 . . 1306 . . 15 ILE CB . 50747 1
76 . 1 . 1 15 15 ILE N N 15 123.095 0.062 . 1 . . 1180 . . 15 ILE N . 50747 1
77 . 1 . 1 16 16 ASN H H 1 8.908 0.002 . 1 . . 1069 . . 16 ASN H . 50747 1
78 . 1 . 1 16 16 ASN HA H 1 4.819 0.01 . 1 . . 1663 . . 16 ASN HA . 50747 1
79 . 1 . 1 16 16 ASN HD21 H 1 7.585 0.001 . 1 . . 1111 . . 16 ASN HD21 . 50747 1
80 . 1 . 1 16 16 ASN HD22 H 1 6.687 0.003 . 1 . . 1613 . . 16 ASN HD22 . 50747 1
81 . 1 . 1 16 16 ASN C C 13 176.036 0.004 . 1 . . 1482 . . 16 ASN C . 50747 1
82 . 1 . 1 16 16 ASN CA C 13 53.356 0.031 . 1 . . 1309 . . 16 ASN CA . 50747 1
83 . 1 . 1 16 16 ASN CB C 13 37.890 0.049 . 1 . . 1308 . . 16 ASN CB . 50747 1
84 . 1 . 1 16 16 ASN N N 15 127.160 0.039 . 1 . . 1070 . . 16 ASN N . 50747 1
85 . 1 . 1 16 16 ASN ND2 N 15 112.204 0.086 . 1 . . 1076 . . 16 ASN ND2 . 50747 1
86 . 1 . 1 17 17 GLU H H 1 9.584 0.002 . 1 . . 1119 . . 17 GLU H . 50747 1
87 . 1 . 1 17 17 GLU HA H 1 4.525 0.003 . 1 . . 1668 . . 17 GLU HA . 50747 1
88 . 1 . 1 17 17 GLU C C 13 176.874 0.003 . 1 . . 1504 . . 17 GLU C . 50747 1
89 . 1 . 1 17 17 GLU CA C 13 56.464 0.031 . 1 . . 1447 . . 17 GLU CA . 50747 1
90 . 1 . 1 17 17 GLU CB C 13 29.102 0.058 . 1 . . 1448 . . 17 GLU CB . 50747 1
91 . 1 . 1 17 17 GLU N N 15 128.473 0.033 . 1 . . 1120 . . 17 GLU N . 50747 1
92 . 1 . 1 18 18 GLU H H 1 7.672 0.002 . 1 . . 1204 . . 18 GLU H . 50747 1
93 . 1 . 1 18 18 GLU HA H 1 4.355 0.004 . 1 . . 1669 . . 18 GLU HA . 50747 1
94 . 1 . 1 18 18 GLU C C 13 177.741 0.004 . 1 . . 1546 . . 18 GLU C . 50747 1
95 . 1 . 1 18 18 GLU CA C 13 58.375 0.069 . 1 . . 1449 . . 18 GLU CA . 50747 1
96 . 1 . 1 18 18 GLU CB C 13 32.072 0.007 . 1 . . 1454 . . 18 GLU CB . 50747 1
97 . 1 . 1 18 18 GLU N N 15 129.400 0.03 . 1 . . 1205 . . 18 GLU N . 50747 1
98 . 1 . 1 19 19 VAL H H 1 10.188 0.002 . 1 . . 1235 . . 19 VAL H . 50747 1
99 . 1 . 1 19 19 VAL HA H 1 4.093 0.002 . 1 . . 1670 . . 19 VAL HA . 50747 1
100 . 1 . 1 19 19 VAL C C 13 175.295 0.007 . 1 . . 1541 . . 19 VAL C . 50747 1
101 . 1 . 1 19 19 VAL CA C 13 65.178 0.023 . 1 . . 1451 . . 19 VAL CA . 50747 1
102 . 1 . 1 19 19 VAL CB C 13 31.686 0.046 . 1 . . 1450 . . 19 VAL CB . 50747 1
103 . 1 . 1 19 19 VAL N N 15 124.408 0.021 . 1 . . 1236 . . 19 VAL N . 50747 1
104 . 1 . 1 20 20 VAL H H 1 8.487 0.002 . 1 . . 1208 . . 20 VAL H . 50747 1
105 . 1 . 1 20 20 VAL HA H 1 4.675 . . 1 . . 1671 . . 20 VAL HA . 50747 1
106 . 1 . 1 20 20 VAL C C 13 175.438 . . 1 . . 1542 . . 20 VAL C . 50747 1
107 . 1 . 1 20 20 VAL CA C 13 58.906 0.03 . 1 . . 1453 . . 20 VAL CA . 50747 1
108 . 1 . 1 20 20 VAL CB C 13 33.520 . . 1 . . 1452 . . 20 VAL CB . 50747 1
109 . 1 . 1 20 20 VAL N N 15 129.522 0.024 . 1 . . 1209 . . 20 VAL N . 50747 1
110 . 1 . 1 21 21 PRO HA H 1 4.683 . . 1 . . 1672 . . 21 PRO HA . 50747 1
111 . 1 . 1 21 21 PRO C C 13 176.645 . . 1 . . 1570 . . 21 PRO C . 50747 1
112 . 1 . 1 21 21 PRO CA C 13 62.233 0.032 . 1 . . 1571 . . 21 PRO CA . 50747 1
113 . 1 . 1 21 21 PRO CB C 13 30.218 0.076 . 1 . . 1572 . . 21 PRO CB . 50747 1
114 . 1 . 1 22 22 ASP H H 1 8.239 0.004 . 1 . . 1063 . . 22 ASP H . 50747 1
115 . 1 . 1 22 22 ASP HA H 1 5.094 0.006 . 1 . . 1626 . . 22 ASP HA . 50747 1
116 . 1 . 1 22 22 ASP C C 13 177.028 0.003 . 1 . . 1534 . . 22 ASP C . 50747 1
117 . 1 . 1 22 22 ASP CA C 13 54.508 0.049 . 1 . . 1317 . . 22 ASP CA . 50747 1
118 . 1 . 1 22 22 ASP CB C 13 43.095 0.101 . 1 . . 1316 . . 22 ASP CB . 50747 1
119 . 1 . 1 22 22 ASP N N 15 116.022 0.049 . 1 . . 1064 . . 22 ASP N . 50747 1
120 . 1 . 1 23 23 VAL H H 1 8.410 0.003 . 1 . . 1187 . . 23 VAL H . 50747 1
121 . 1 . 1 23 23 VAL HA H 1 5.073 0.004 . 1 . . 1627 . . 23 VAL HA . 50747 1
122 . 1 . 1 23 23 VAL C C 13 174.646 0.002 . 1 . . 1518 . . 23 VAL C . 50747 1
123 . 1 . 1 23 23 VAL CA C 13 61.169 0.061 . 1 . . 1315 . . 23 VAL CA . 50747 1
124 . 1 . 1 23 23 VAL CB C 13 34.952 0.076 . 1 . . 1314 . . 23 VAL CB . 50747 1
125 . 1 . 1 23 23 VAL N N 15 121.817 0.042 . 1 . . 1188 . . 23 VAL N . 50747 1
126 . 1 . 1 24 24 ARG H H 1 9.142 0.005 . 1 . . 1151 . . 24 ARG H . 50747 1
127 . 1 . 1 24 24 ARG HA H 1 5.017 0.006 . 1 . . 1628 . . 24 ARG HA . 50747 1
128 . 1 . 1 24 24 ARG C C 13 174.641 0.003 . 1 . . 1483 . . 24 ARG C . 50747 1
129 . 1 . 1 24 24 ARG CA C 13 55.251 0.084 . 1 . . 1311 . . 24 ARG CA . 50747 1
130 . 1 . 1 24 24 ARG CB C 13 33.548 0.133 . 1 . . 1310 . . 24 ARG CB . 50747 1
131 . 1 . 1 24 24 ARG N N 15 128.150 0.034 . 1 . . 1152 . . 24 ARG N . 50747 1
132 . 1 . 1 25 25 LEU H H 1 9.157 0.005 . 1 . . 1071 . . 25 LEU H . 50747 1
133 . 1 . 1 25 25 LEU HA H 1 5.991 0.003 . 1 . . 1629 . . 25 LEU HA . 50747 1
134 . 1 . 1 25 25 LEU C C 13 177.470 0.007 . 1 . . 1484 . . 25 LEU C . 50747 1
135 . 1 . 1 25 25 LEU CA C 13 54.409 0.041 . 1 . . 1313 . . 25 LEU CA . 50747 1
136 . 1 . 1 25 25 LEU CB C 13 46.274 0.06 . 1 . . 1312 . . 25 LEU CB . 50747 1
137 . 1 . 1 25 25 LEU N N 15 123.690 0.036 . 1 . . 1072 . . 25 LEU N . 50747 1
138 . 1 . 1 26 26 THR H H 1 9.819 0.003 . 1 . . 1173 . . 26 THR H . 50747 1
139 . 1 . 1 26 26 THR HA H 1 5.225 0.004 . 1 . . 1630 . . 26 THR HA . 50747 1
140 . 1 . 1 26 26 THR C C 13 172.022 0.008 . 1 . . 1529 . . 26 THR C . 50747 1
141 . 1 . 1 26 26 THR CA C 13 60.389 0.051 . 1 . . 1432 . . 26 THR CA . 50747 1
142 . 1 . 1 26 26 THR CB C 13 71.503 0.021 . 1 . . 1433 . . 26 THR CB . 50747 1
143 . 1 . 1 26 26 THR N N 15 115.803 0.046 . 1 . . 1174 . . 26 THR N . 50747 1
144 . 1 . 1 27 27 ARG H H 1 9.182 0.003 . 1 . . 1260 . . 27 ARG H . 50747 1
145 . 1 . 1 27 27 ARG HA H 1 4.749 0.018 . 1 . . 1631 . . 27 ARG HA . 50747 1
146 . 1 . 1 27 27 ARG C C 13 175.508 0.007 . 1 . . 1530 . . 27 ARG C . 50747 1
147 . 1 . 1 27 27 ARG CA C 13 55.178 0.068 . 1 . . 1428 . . 27 ARG CA . 50747 1
148 . 1 . 1 27 27 ARG CB C 13 35.490 0.059 . 1 . . 1429 . . 27 ARG CB . 50747 1
149 . 1 . 1 27 27 ARG N N 15 121.250 0.031 . 1 . . 1261 . . 27 ARG N . 50747 1
150 . 1 . 1 28 28 ALA H H 1 8.472 0.009 . 1 . . 1175 . . 28 ALA H . 50747 1
151 . 1 . 1 28 28 ALA HA H 1 4.547 0.004 . 1 . . 1632 . . 28 ALA HA . 50747 1
152 . 1 . 1 28 28 ALA C C 13 170.116 0.011 . 1 . . 1531 . . 28 ALA C . 50747 1
153 . 1 . 1 28 28 ALA CA C 13 52.160 0.038 . 1 . . 1431 . . 28 ALA CA . 50747 1
154 . 1 . 1 28 28 ALA CB C 13 20.092 0.052 . 1 . . 1430 . . 28 ALA CB . 50747 1
155 . 1 . 1 28 28 ALA N N 15 127.788 0.059 . 1 . . 1176 . . 28 ALA N . 50747 1
156 . 1 . 1 29 29 ARG H H 1 9.000 0.005 . 1 . . 1621 . . 29 ARG H . 50747 1
157 . 1 . 1 29 29 ARG HA H 1 3.980 0.005 . 1 . . 1673 . . 29 ARG HA . 50747 1
158 . 1 . 1 29 29 ARG C C 13 176.985 0.014 . 1 . . 1623 . . 29 ARG C . 50747 1
159 . 1 . 1 29 29 ARG CA C 13 59.822 0.056 . 1 . . 1624 . . 29 ARG CA . 50747 1
160 . 1 . 1 29 29 ARG CB C 13 29.805 0.032 . 1 . . 1748 . . 29 ARG CB . 50747 1
161 . 1 . 1 29 29 ARG N N 15 124.110 0.063 . 1 . . 1622 . . 29 ARG N . 50747 1
162 . 1 . 1 30 30 ASP H H 1 7.857 0.003 . 1 . . 1165 . . 30 ASP H . 50747 1
163 . 1 . 1 30 30 ASP HA H 1 4.509 0.009 . 1 . . 1633 . . 30 ASP HA . 50747 1
164 . 1 . 1 30 30 ASP C C 13 177.794 0.008 . 1 . . 1485 . . 30 ASP C . 50747 1
165 . 1 . 1 30 30 ASP CA C 13 52.928 0.05 . 1 . . 1319 . . 30 ASP CA . 50747 1
166 . 1 . 1 30 30 ASP CB C 13 40.184 0.054 . 1 . . 1318 . . 30 ASP CB . 50747 1
167 . 1 . 1 30 30 ASP N N 15 114.079 0.047 . 1 . . 1166 . . 30 ASP N . 50747 1
168 . 1 . 1 31 31 GLY H H 1 8.015 0.002 . 1 . . 1073 . . 31 GLY H . 50747 1
169 . 1 . 1 31 31 GLY HA2 H 1 3.150 0.007 . 2 . . 1636 . . 31 GLY HA2 . 50747 1
170 . 1 . 1 31 31 GLY HA3 H 1 3.919 0.006 . 2 . . 1637 . . 31 GLY HA3 . 50747 1
171 . 1 . 1 31 31 GLY C C 13 175.158 0.005 . 1 . . 1561 . . 31 GLY C . 50747 1
172 . 1 . 1 31 31 GLY CA C 13 45.186 0.064 . 1 . . 1320 . . 31 GLY CA . 50747 1
173 . 1 . 1 31 31 GLY N N 15 106.933 0.028 . 1 . . 1074 . . 31 GLY N . 50747 1
174 . 1 . 1 32 32 SER H H 1 8.066 0.002 . 1 . . 1101 . . 32 SER H . 50747 1
175 . 1 . 1 32 32 SER HA H 1 3.809 0.014 . 1 . . 1635 . . 32 SER HA . 50747 1
176 . 1 . 1 32 32 SER C C 13 172.984 . . 1 . . 1560 . . 32 SER C . 50747 1
177 . 1 . 1 32 32 SER CA C 13 61.071 0.052 . 1 . . 1350 . . 32 SER CA . 50747 1
178 . 1 . 1 32 32 SER CB C 13 63.469 0.039 . 1 . . 1351 . . 32 SER CB . 50747 1
179 . 1 . 1 32 32 SER N N 15 115.036 0.025 . 1 . . 1102 . . 32 SER N . 50747 1
180 . 1 . 1 33 33 SER H H 1 6.908 0.002 . 1 . . 1219 . . 33 SER H . 50747 1
181 . 1 . 1 33 33 SER HA H 1 4.462 0.009 . 1 . . 1634 . . 33 SER HA . 50747 1
182 . 1 . 1 33 33 SER C C 13 173.301 0.006 . 1 . . 1559 . . 33 SER C . 50747 1
183 . 1 . 1 33 33 SER CA C 13 57.154 0.049 . 1 . . 1348 . . 33 SER CA . 50747 1
184 . 1 . 1 33 33 SER CB C 13 65.321 0.068 . 1 . . 1349 . . 33 SER CB . 50747 1
185 . 1 . 1 33 33 SER N N 15 109.888 0.038 . 1 . . 1220 . . 33 SER N . 50747 1
186 . 1 . 1 34 34 GLY H H 1 8.849 0.002 . 1 . . 1083 . . 34 GLY H . 50747 1
187 . 1 . 1 34 34 GLY HA2 H 1 4.437 0.007 . 2 . . 1638 . . 34 GLY HA2 . 50747 1
188 . 1 . 1 34 34 GLY HA3 H 1 4.850 0.015 . 2 . . 1639 . . 34 GLY HA3 . 50747 1
189 . 1 . 1 34 34 GLY C C 13 171.461 0.009 . 1 . . 1558 . . 34 GLY C . 50747 1
190 . 1 . 1 34 34 GLY CA C 13 46.768 0.049 . 1 . . 1347 . . 34 GLY CA . 50747 1
191 . 1 . 1 34 34 GLY N N 15 106.174 0.047 . 1 . . 1084 . . 34 GLY N . 50747 1
192 . 1 . 1 35 35 GLN H H 1 9.119 0.002 . 1 . . 1185 . . 35 GLN H . 50747 1
193 . 1 . 1 35 35 GLN HA H 1 5.209 0.005 . 1 . . 1640 . . 35 GLN HA . 50747 1
194 . 1 . 1 35 35 GLN HE21 H 1 7.358 0.001 . 1 . . 1075 . . 35 GLN HE21 . 50747 1
195 . 1 . 1 35 35 GLN HE22 H 1 6.842 0.001 . 1 . . 1087 . . 35 GLN HE22 . 50747 1
196 . 1 . 1 35 35 GLN C C 13 172.606 0.002 . 1 . . 1512 . . 35 GLN C . 50747 1
197 . 1 . 1 35 35 GLN CA C 13 55.587 0.05 . 1 . . 1345 . . 35 GLN CA . 50747 1
198 . 1 . 1 35 35 GLN CB C 13 34.599 0.036 . 1 . . 1346 . . 35 GLN CB . 50747 1
199 . 1 . 1 35 35 GLN N N 15 119.192 0.021 . 1 . . 1186 . . 35 GLN N . 50747 1
200 . 1 . 1 35 35 GLN NE2 N 15 112.139 0.032 . 1 . . 1088 . . 35 GLN NE2 . 50747 1
201 . 1 . 1 36 36 ALA H H 1 8.872 0.005 . 1 . . 1139 . . 36 ALA H . 50747 1
202 . 1 . 1 36 36 ALA HA H 1 5.347 0.002 . 1 . . 1641 . . 36 ALA HA . 50747 1
203 . 1 . 1 36 36 ALA C C 13 175.004 0.013 . 1 . . 1557 . . 36 ALA C . 50747 1
204 . 1 . 1 36 36 ALA CA C 13 50.184 0.073 . 1 . . 1343 . . 36 ALA CA . 50747 1
205 . 1 . 1 36 36 ALA CB C 13 24.223 0.021 . 1 . . 1342 . . 36 ALA CB . 50747 1
206 . 1 . 1 36 36 ALA N N 15 123.558 0.026 . 1 . . 1140 . . 36 ALA N . 50747 1
207 . 1 . 1 37 37 MET H H 1 9.418 0.006 . 1 . . 1093 . . 37 MET H . 50747 1
208 . 1 . 1 37 37 MET HA H 1 5.323 0.008 . 1 . . 1642 . . 37 MET HA . 50747 1
209 . 1 . 1 37 37 MET C C 13 174.883 0.013 . 1 . . 1492 . . 37 MET C . 50747 1
210 . 1 . 1 37 37 MET CA C 13 55.694 0.035 . 1 . . 1414 . . 37 MET CA . 50747 1
211 . 1 . 1 37 37 MET CB C 13 33.001 0.024 . 1 . . 1344 . . 37 MET CB . 50747 1
212 . 1 . 1 37 37 MET N N 15 123.502 0.02 . 1 . . 1094 . . 37 MET N . 50747 1
213 . 1 . 1 38 38 PHE H H 1 9.903 0.007 . 1 . . 1147 . . 38 PHE H . 50747 1
214 . 1 . 1 38 38 PHE HA H 1 5.244 0.01 . 1 . . 1675 . . 38 PHE HA . 50747 1
215 . 1 . 1 38 38 PHE C C 13 175.833 0.008 . 1 . . 1515 . . 38 PHE C . 50747 1
216 . 1 . 1 38 38 PHE CA C 13 56.542 0.028 . 1 . . 1463 . . 38 PHE CA . 50747 1
217 . 1 . 1 38 38 PHE CB C 13 43.043 0.066 . 1 . . 1464 . . 38 PHE CB . 50747 1
218 . 1 . 1 38 38 PHE N N 15 122.565 0.07 . 1 . . 1148 . . 38 PHE N . 50747 1
219 . 1 . 1 39 39 TYR H H 1 8.942 0.003 . 1 . . 1250 . . 39 TYR H . 50747 1
220 . 1 . 1 39 39 TYR HA H 1 5.256 0.008 . 1 . . 1677 . . 39 TYR HA . 50747 1
221 . 1 . 1 39 39 TYR C C 13 173.910 . . 1 . . 1550 . . 39 TYR C . 50747 1
222 . 1 . 1 39 39 TYR CA C 13 58.296 0.027 . 1 . . 1465 . . 39 TYR CA . 50747 1
223 . 1 . 1 39 39 TYR CB C 13 41.687 0.007 . 1 . . 1580 . . 39 TYR CB . 50747 1
224 . 1 . 1 39 39 TYR N N 15 124.116 0.066 . 1 . . 1251 . . 39 TYR N . 50747 1
225 . 1 . 1 40 40 PHE H H 1 8.983 0.005 . 1 . . 1242 . . 40 PHE H . 50747 1
226 . 1 . 1 40 40 PHE HA H 1 4.629 0.005 . 1 . . 1676 . . 40 PHE HA . 50747 1
227 . 1 . 1 40 40 PHE C C 13 173.793 0.013 . 1 . . 1540 . . 40 PHE C . 50747 1
228 . 1 . 1 40 40 PHE CA C 13 55.646 0.048 . 1 . . 1373 . . 40 PHE CA . 50747 1
229 . 1 . 1 40 40 PHE CB C 13 40.959 0.099 . 1 . . 1372 . . 40 PHE CB . 50747 1
230 . 1 . 1 40 40 PHE N N 15 124.271 0.036 . 1 . . 1243 . . 40 PHE N . 50747 1
231 . 1 . 1 41 41 ASP H H 1 9.018 0.002 . 1 . . 1206 . . 41 ASP H . 50747 1
232 . 1 . 1 41 41 ASP HA H 1 4.525 0.004 . 1 . . 1674 . . 41 ASP HA . 50747 1
233 . 1 . 1 41 41 ASP C C 13 174.880 0.011 . 1 . . 1495 . . 41 ASP C . 50747 1
234 . 1 . 1 41 41 ASP CA C 13 53.960 0.085 . 1 . . 1369 . . 41 ASP CA . 50747 1
235 . 1 . 1 41 41 ASP CB C 13 41.602 0.027 . 1 . . 1368 . . 41 ASP CB . 50747 1
236 . 1 . 1 41 41 ASP N N 15 125.176 0.048 . 1 . . 1207 . . 41 ASP N . 50747 1
237 . 1 . 1 42 42 ASN H H 1 8.249 0.002 . 1 . . 1099 . . 42 ASN H . 50747 1
238 . 1 . 1 42 42 ASN HD21 H 1 6.567 0.002 . 1 . . 1227 . . 42 ASN HD21 . 50747 1
239 . 1 . 1 42 42 ASN HD22 H 1 7.417 0.001 . 1 . . 1237 . . 42 ASN HD22 . 50747 1
240 . 1 . 1 42 42 ASN C C 13 171.526 . . 1 . . 1496 . . 42 ASN C . 50747 1
241 . 1 . 1 42 42 ASN CA C 13 54.002 0.084 . 1 . . 1371 . . 42 ASN CA . 50747 1
242 . 1 . 1 42 42 ASN CB C 13 38.281 0.01 . 1 . . 1370 . . 42 ASN CB . 50747 1
243 . 1 . 1 42 42 ASN N N 15 121.914 0.044 . 1 . . 1100 . . 42 ASN N . 50747 1
244 . 1 . 1 42 42 ASN ND2 N 15 109.442 0.047 . 1 . . 1228 . . 42 ASN ND2 . 50747 1
245 . 1 . 1 43 43 PRO HA H 1 4.601 . . 1 . . 1678 . . 43 PRO HA . 50747 1
246 . 1 . 1 43 43 PRO C C 13 176.772 0.001 . 1 . . 1593 . . 43 PRO C . 50747 1
247 . 1 . 1 43 43 PRO CA C 13 62.435 0.053 . 1 . . 1591 . . 43 PRO CA . 50747 1
248 . 1 . 1 43 43 PRO CB C 13 30.719 0.026 . 1 . . 1590 . . 43 PRO CB . 50747 1
249 . 1 . 1 44 44 LYS H H 1 11.583 0.003 . 1 . . 1143 . . 44 LYS H . 50747 1
250 . 1 . 1 44 44 LYS HA H 1 3.836 0.004 . 1 . . 1679 . . 44 LYS HA . 50747 1
251 . 1 . 1 44 44 LYS C C 13 170.089 0.004 . 1 . . 1592 . . 44 LYS C . 50747 1
252 . 1 . 1 44 44 LYS CA C 13 58.994 0.068 . 1 . . 1589 . . 44 LYS CA . 50747 1
253 . 1 . 1 44 44 LYS CB C 13 30.785 0.059 . 1 . . 1588 . . 44 LYS CB . 50747 1
254 . 1 . 1 44 44 LYS N N 15 126.866 0.024 . 1 . . 1144 . . 44 LYS N . 50747 1
255 . 1 . 1 45 45 ILE H H 1 8.328 0.002 . 1 . . 1089 . . 45 ILE H . 50747 1
256 . 1 . 1 45 45 ILE HA H 1 4.191 0.013 . 1 . . 1680 . . 45 ILE HA . 50747 1
257 . 1 . 1 45 45 ILE C C 13 176.226 0.013 . 1 . . 1478 . . 45 ILE C . 50747 1
258 . 1 . 1 45 45 ILE CA C 13 61.467 0.039 . 1 . . 1329 . . 45 ILE CA . 50747 1
259 . 1 . 1 45 45 ILE CB C 13 37.712 0.023 . 1 . . 1330 . . 45 ILE CB . 50747 1
260 . 1 . 1 45 45 ILE N N 15 115.573 0.033 . 1 . . 1090 . . 45 ILE N . 50747 1
261 . 1 . 1 46 46 VAL H H 1 6.785 0.001 . 1 . . 1085 . . 46 VAL H . 50747 1
262 . 1 . 1 46 46 VAL HA H 1 4.169 0.009 . 1 . . 1681 . . 46 VAL HA . 50747 1
263 . 1 . 1 46 46 VAL C C 13 177.328 0.003 . 1 . . 1477 . . 46 VAL C . 50747 1
264 . 1 . 1 46 46 VAL CA C 13 62.655 0.038 . 1 . . 1325 . . 46 VAL CA . 50747 1
265 . 1 . 1 46 46 VAL CB C 13 31.126 0.045 . 1 . . 1326 . . 46 VAL CB . 50747 1
266 . 1 . 1 46 46 VAL N N 15 114.004 0.021 . 1 . . 1086 . . 46 VAL N . 50747 1
267 . 1 . 1 47 47 GLN H H 1 7.769 0.001 . 1 . . 1079 . . 47 GLN H . 50747 1
268 . 1 . 1 47 47 GLN HA H 1 4.136 0.011 . 1 . . 1682 . . 47 GLN HA . 50747 1
269 . 1 . 1 47 47 GLN HE21 H 1 7.240 0.001 . 1 . . 1189 . . 47 GLN HE21 . 50747 1
270 . 1 . 1 47 47 GLN HE22 H 1 7.001 0.002 . 1 . . 1199 . . 47 GLN HE22 . 50747 1
271 . 1 . 1 47 47 GLN C C 13 177.480 0.005 . 1 . . 1476 . . 47 GLN C . 50747 1
272 . 1 . 1 47 47 GLN CA C 13 57.931 0.016 . 1 . . 1328 . . 47 GLN CA . 50747 1
273 . 1 . 1 47 47 GLN CB C 13 29.164 0.039 . 1 . . 1327 . . 47 GLN CB . 50747 1
274 . 1 . 1 47 47 GLN N N 15 121.000 0.021 . 1 . . 1080 . . 47 GLN N . 50747 1
275 . 1 . 1 47 47 GLN NE2 N 15 113.138 0.043 . 1 . . 1190 . . 47 GLN NE2 . 50747 1
276 . 1 . 1 48 48 GLU H H 1 7.895 0.001 . 1 . . 1278 . . 48 GLU H . 50747 1
277 . 1 . 1 48 48 GLU HA H 1 4.296 0.011 . 1 . . 1683 . . 48 GLU HA . 50747 1
278 . 1 . 1 48 48 GLU C C 13 176.910 0.006 . 1 . . 1475 . . 48 GLU C . 50747 1
279 . 1 . 1 48 48 GLU CA C 13 56.440 0.035 . 1 . . 1385 . . 48 GLU CA . 50747 1
280 . 1 . 1 48 48 GLU CB C 13 30.383 0.031 . 1 . . 1384 . . 48 GLU CB . 50747 1
281 . 1 . 1 48 48 GLU N N 15 116.240 0.022 . 1 . . 1279 . . 48 GLU N . 50747 1
282 . 1 . 1 49 49 GLY H H 1 7.931 0.003 . 1 . . 1183 . . 49 GLY H . 50747 1
283 . 1 . 1 49 49 GLY HA2 H 1 3.757 . . 2 . . 1684 . . 49 GLY HA2 . 50747 1
284 . 1 . 1 49 49 GLY HA3 H 1 4.108 . . 2 . . 1685 . . 49 GLY HA3 . 50747 1
285 . 1 . 1 49 49 GLY C C 13 173.805 0.003 . 1 . . 1474 . . 49 GLY C . 50747 1
286 . 1 . 1 49 49 GLY CA C 13 45.718 0.016 . 1 . . 1383 . . 49 GLY CA . 50747 1
287 . 1 . 1 49 49 GLY N N 15 107.613 0.031 . 1 . . 1184 . . 49 GLY N . 50747 1
288 . 1 . 1 50 50 ASN H H 1 8.111 0.003 . 1 . . 1252 . . 50 ASN H . 50747 1
289 . 1 . 1 50 50 ASN HA H 1 4.701 . . 1 . . 1686 . . 50 ASN HA . 50747 1
290 . 1 . 1 50 50 ASN C C 13 174.218 0.007 . 1 . . 1473 . . 50 ASN C . 50747 1
291 . 1 . 1 50 50 ASN CA C 13 53.254 0.041 . 1 . . 1381 . . 50 ASN CA . 50747 1
292 . 1 . 1 50 50 ASN CB C 13 38.837 0.025 . 1 . . 1382 . . 50 ASN CB . 50747 1
293 . 1 . 1 50 50 ASN N N 15 118.194 0.053 . 1 . . 1253 . . 50 ASN N . 50747 1
294 . 1 . 1 51 51 LEU H H 1 8.116 0.001 . 1 . . 1059 . . 51 LEU H . 50747 1
295 . 1 . 1 51 51 LEU HA H 1 4.263 0.001 . 1 . . 1687 . . 51 LEU HA . 50747 1
296 . 1 . 1 51 51 LEU C C 13 176.668 0.001 . 1 . . 1471 . . 51 LEU C . 50747 1
297 . 1 . 1 51 51 LEU CA C 13 54.989 0.015 . 1 . . 1379 . . 51 LEU CA . 50747 1
298 . 1 . 1 51 51 LEU CB C 13 42.606 0.016 . 1 . . 1378 . . 51 LEU CB . 50747 1
299 . 1 . 1 51 51 LEU N N 15 121.059 0.032 . 1 . . 1060 . . 51 LEU N . 50747 1
300 . 1 . 1 52 52 GLU H H 1 8.265 0.002 . 1 . . 1114 . . 52 GLU H . 50747 1
301 . 1 . 1 52 52 GLU HA H 1 4.429 0.0 . 1 . . 1689 . . 52 GLU HA . 50747 1
302 . 1 . 1 52 52 GLU C C 13 175.369 0.002 . 1 . . 1472 . . 52 GLU C . 50747 1
303 . 1 . 1 52 52 GLU CA C 13 55.679 0.003 . 1 . . 1610 . . 52 GLU CA . 50747 1
304 . 1 . 1 52 52 GLU CB C 13 30.109 0.005 . 1 . . 1609 . . 52 GLU CB . 50747 1
305 . 1 . 1 52 52 GLU N N 15 123.159 0.053 . 1 . . 1115 . . 52 GLU N . 50747 1
306 . 1 . 1 53 53 VAL H H 1 8.260 0.002 . 1 . . 1469 . . 53 VAL H . 50747 1
307 . 1 . 1 53 53 VAL HA H 1 4.298 0.011 . 1 . . 1688 . . 53 VAL HA . 50747 1
308 . 1 . 1 53 53 VAL C C 13 176.234 0.002 . 1 . . 1601 . . 53 VAL C . 50747 1
309 . 1 . 1 53 53 VAL CA C 13 61.748 0.002 . 1 . . 1380 . . 53 VAL CA . 50747 1
310 . 1 . 1 53 53 VAL CB C 13 32.803 0.005 . 1 . . 1608 . . 53 VAL CB . 50747 1
311 . 1 . 1 53 53 VAL N N 15 123.093 0.05 . 1 . . 1470 . . 53 VAL N . 50747 1
312 . 1 . 1 54 54 THR H H 1 8.846 0.007 . 1 . . 1586 . . 54 THR H . 50747 1
313 . 1 . 1 54 54 THR HA H 1 4.484 . . 1 . . 1690 . . 54 THR HA . 50747 1
314 . 1 . 1 54 54 THR C C 13 174.584 0.006 . 1 . . 1602 . . 54 THR C . 50747 1
315 . 1 . 1 54 54 THR CA C 13 61.452 0.045 . 1 . . 1599 . . 54 THR CA . 50747 1
316 . 1 . 1 54 54 THR CB C 13 70.411 0.019 . 1 . . 1600 . . 54 THR CB . 50747 1
317 . 1 . 1 54 54 THR N N 15 115.311 0.087 . 1 . . 1587 . . 54 THR N . 50747 1
318 . 1 . 1 55 55 GLY H H 1 7.669 0.001 . 1 . . 1244 . . 55 GLY H . 50747 1
319 . 1 . 1 55 55 GLY HA2 H 1 3.564 0.001 . 2 . . 1691 . . 55 GLY HA2 . 50747 1
320 . 1 . 1 55 55 GLY HA3 H 1 4.149 0.005 . 2 . . 1692 . . 55 GLY HA3 . 50747 1
321 . 1 . 1 55 55 GLY C C 13 179.343 0.002 . 1 . . 1544 . . 55 GLY C . 50747 1
322 . 1 . 1 55 55 GLY CA C 13 45.184 0.033 . 1 . . 1455 . . 55 GLY CA . 50747 1
323 . 1 . 1 55 55 GLY N N 15 109.152 0.033 . 1 . . 1245 . . 55 GLY N . 50747 1
324 . 1 . 1 56 56 MET H H 1 8.047 0.002 . 1 . . 1221 . . 56 MET H . 50747 1
325 . 1 . 1 56 56 MET HA H 1 4.336 0.004 . 1 . . 1693 . . 56 MET HA . 50747 1
326 . 1 . 1 56 56 MET C C 13 172.376 0.005 . 1 . . 1486 . . 56 MET C . 50747 1
327 . 1 . 1 56 56 MET CA C 13 55.127 0.022 . 1 . . 1321 . . 56 MET CA . 50747 1
328 . 1 . 1 56 56 MET CB C 13 37.449 0.056 . 1 . . 1322 . . 56 MET CB . 50747 1
329 . 1 . 1 56 56 MET N N 15 117.796 0.025 . 1 . . 1222 . . 56 MET N . 50747 1
330 . 1 . 1 57 57 TYR H H 1 9.065 0.002 . 1 . . 1077 . . 57 TYR H . 50747 1
331 . 1 . 1 57 57 TYR HA H 1 4.680 0.0 . 1 . . 1694 . . 57 TYR HA . 50747 1
332 . 1 . 1 57 57 TYR C C 13 174.344 0.01 . 1 . . 1487 . . 57 TYR C . 50747 1
333 . 1 . 1 57 57 TYR CA C 13 56.418 0.026 . 1 . . 1324 . . 57 TYR CA . 50747 1
334 . 1 . 1 57 57 TYR CB C 13 39.244 0.042 . 1 . . 1323 . . 57 TYR CB . 50747 1
335 . 1 . 1 57 57 TYR N N 15 125.026 0.035 . 1 . . 1078 . . 57 TYR N . 50747 1
336 . 1 . 1 58 58 MET H H 1 8.911 0.003 . 1 . . 1420 . . 58 MET H . 50747 1
337 . 1 . 1 58 58 MET HA H 1 4.141 0.011 . 1 . . 1695 . . 58 MET HA . 50747 1
338 . 1 . 1 58 58 MET C C 13 174.044 0.0 . 1 . . 1556 . . 58 MET C . 50747 1
339 . 1 . 1 58 58 MET CA C 13 54.630 0.063 . 1 . . 1446 . . 58 MET CA . 50747 1
340 . 1 . 1 58 58 MET CB C 13 34.146 0.027 . 1 . . 1445 . . 58 MET CB . 50747 1
341 . 1 . 1 58 58 MET N N 15 125.136 0.048 . 1 . . 1421 . . 58 MET N . 50747 1
342 . 1 . 1 59 59 VAL H H 1 8.778 0.002 . 1 . . 1280 . . 59 VAL H . 50747 1
343 . 1 . 1 59 59 VAL HA H 1 4.885 0.009 . 1 . . 1696 . . 59 VAL HA . 50747 1
344 . 1 . 1 59 59 VAL C C 13 174.152 0.011 . 1 . . 1538 . . 59 VAL C . 50747 1
345 . 1 . 1 59 59 VAL CA C 13 60.274 0.042 . 1 . . 1444 . . 59 VAL CA . 50747 1
346 . 1 . 1 59 59 VAL CB C 13 34.891 0.053 . 1 . . 1443 . . 59 VAL CB . 50747 1
347 . 1 . 1 59 59 VAL N N 15 121.057 0.029 . 1 . . 1281 . . 59 VAL N . 50747 1
348 . 1 . 1 60 60 ASP H H 1 8.929 0.002 . 1 . . 1202 . . 60 ASP H . 50747 1
349 . 1 . 1 60 60 ASP HA H 1 5.041 0.0 . 1 . . 1697 . . 60 ASP HA . 50747 1
350 . 1 . 1 60 60 ASP C C 13 178.264 . . 1 . . 1539 . . 60 ASP C . 50747 1
351 . 1 . 1 60 60 ASP CA C 13 53.716 0.036 . 1 . . 1585 . . 60 ASP CA . 50747 1
352 . 1 . 1 60 60 ASP CB C 13 43.335 0.082 . 1 . . 1573 . . 60 ASP CB . 50747 1
353 . 1 . 1 60 60 ASP N N 15 125.368 0.127 . 1 . . 1203 . . 60 ASP N . 50747 1
354 . 1 . 1 61 61 GLU H H 1 9.010 0.002 . 1 . . 1121 . . 61 GLU H . 50747 1
355 . 1 . 1 61 61 GLU HA H 1 4.222 0.012 . 1 . . 1698 . . 61 GLU HA . 50747 1
356 . 1 . 1 61 61 GLU C C 13 177.296 0.005 . 1 . . 1502 . . 61 GLU C . 50747 1
357 . 1 . 1 61 61 GLU CA C 13 58.185 0.018 . 1 . . 1304 . . 61 GLU CA . 50747 1
358 . 1 . 1 61 61 GLU CB C 13 29.755 0.044 . 1 . . 1305 . . 61 GLU CB . 50747 1
359 . 1 . 1 61 61 GLU N N 15 114.642 0.03 . 1 . . 1122 . . 61 GLU N . 50747 1
360 . 1 . 1 62 62 GLU H H 1 8.565 0.002 . 1 . . 1117 . . 62 GLU H . 50747 1
361 . 1 . 1 62 62 GLU HA H 1 4.322 0.002 . 1 . . 1699 . . 62 GLU HA . 50747 1
362 . 1 . 1 62 62 GLU C C 13 176.087 0.004 . 1 . . 1503 . . 62 GLU C . 50747 1
363 . 1 . 1 62 62 GLU CA C 13 57.073 0.019 . 1 . . 1303 . . 62 GLU CA . 50747 1
364 . 1 . 1 62 62 GLU CB C 13 31.217 0.036 . 1 . . 1302 . . 62 GLU CB . 50747 1
365 . 1 . 1 62 62 GLU N N 15 120.262 0.041 . 1 . . 1118 . . 62 GLU N . 50747 1
366 . 1 . 1 63 63 GLY H H 1 7.911 0.001 . 1 . . 1254 . . 63 GLY H . 50747 1
367 . 1 . 1 63 63 GLY HA2 H 1 4.562 0.001 . 1 . . 1700 . . 63 GLY HA2 . 50747 1
368 . 1 . 1 63 63 GLY HA3 H 1 4.562 0.001 . 1 . . 1701 . . 63 GLY HA3 . 50747 1
369 . 1 . 1 63 63 GLY C C 13 170.235 0.001 . 1 . . 1532 . . 63 GLY C . 50747 1
370 . 1 . 1 63 63 GLY CA C 13 44.893 0.039 . 1 . . 1301 . . 63 GLY CA . 50747 1
371 . 1 . 1 63 63 GLY N N 15 109.123 0.026 . 1 . . 1255 . . 63 GLY N . 50747 1
372 . 1 . 1 64 64 GLU H H 1 8.218 0.001 . 1 . . 1181 . . 64 GLU H . 50747 1
373 . 1 . 1 64 64 GLU HA H 1 5.491 0.0 . 1 . . 1702 . . 64 GLU HA . 50747 1
374 . 1 . 1 64 64 GLU C C 13 176.032 0.002 . 1 . . 1533 . . 64 GLU C . 50747 1
375 . 1 . 1 64 64 GLU CA C 13 53.926 0.034 . 1 . . 1299 . . 64 GLU CA . 50747 1
376 . 1 . 1 64 64 GLU CB C 13 33.895 0.023 . 1 . . 1300 . . 64 GLU CB . 50747 1
377 . 1 . 1 64 64 GLU N N 15 119.372 0.034 . 1 . . 1182 . . 64 GLU N . 50747 1
378 . 1 . 1 65 65 ILE H H 1 9.277 0.003 . 1 . . 1274 . . 65 ILE H . 50747 1
379 . 1 . 1 65 65 ILE HA H 1 4.192 0.003 . 1 . . 1703 . . 65 ILE HA . 50747 1
380 . 1 . 1 65 65 ILE C C 13 174.302 0.009 . 1 . . 1552 . . 65 ILE C . 50747 1
381 . 1 . 1 65 65 ILE CA C 13 60.748 0.008 . 1 . . 1298 . . 65 ILE CA . 50747 1
382 . 1 . 1 65 65 ILE CB C 13 40.724 0.022 . 1 . . 1297 . . 65 ILE CB . 50747 1
383 . 1 . 1 65 65 ILE N N 15 126.257 0.028 . 1 . . 1275 . . 65 ILE N . 50747 1
384 . 1 . 1 66 66 VAL H H 1 8.344 0.002 . 1 . . 1262 . . 66 VAL H . 50747 1
385 . 1 . 1 66 66 VAL HA H 1 4.863 0.006 . 1 . . 1704 . . 66 VAL HA . 50747 1
386 . 1 . 1 66 66 VAL C C 13 175.143 . . 1 . . 1553 . . 66 VAL C . 50747 1
387 . 1 . 1 66 66 VAL CA C 13 59.971 0.051 . 1 . . 1293 . . 66 VAL CA . 50747 1
388 . 1 . 1 66 66 VAL CB C 13 35.382 0.024 . 1 . . 1294 . . 66 VAL CB . 50747 1
389 . 1 . 1 66 66 VAL N N 15 124.036 0.045 . 1 . . 1263 . . 66 VAL N . 50747 1
390 . 1 . 1 67 67 THR H H 1 7.996 0.002 . 1 . . 1065 . . 67 THR H . 50747 1
391 . 1 . 1 67 67 THR HA H 1 4.942 . . 1 . . 1705 . . 67 THR HA . 50747 1
392 . 1 . 1 67 67 THR C C 13 171.741 0.001 . 1 . . 1511 . . 67 THR C . 50747 1
393 . 1 . 1 67 67 THR CA C 13 58.051 0.06 . 1 . . 1296 . . 67 THR CA . 50747 1
394 . 1 . 1 67 67 THR CB C 13 70.871 0.092 . 1 . . 1295 . . 67 THR CB . 50747 1
395 . 1 . 1 67 67 THR N N 15 116.019 0.022 . 1 . . 1066 . . 67 THR N . 50747 1
396 . 1 . 1 68 68 ARG H H 1 9.011 0.003 . 1 . . 1135 . . 68 ARG H . 50747 1
397 . 1 . 1 68 68 ARG HA H 1 4.686 . . 1 . . 1706 . . 68 ARG HA . 50747 1
398 . 1 . 1 68 68 ARG C C 13 175.962 . . 1 . . 1568 . . 68 ARG C . 50747 1
399 . 1 . 1 68 68 ARG CA C 13 54.795 0.006 . 1 . . 1409 . . 68 ARG CA . 50747 1
400 . 1 . 1 68 68 ARG CB C 13 29.780 . . 1 . . 1408 . . 68 ARG CB . 50747 1
401 . 1 . 1 68 68 ARG N N 15 124.833 0.069 . 1 . . 1136 . . 68 ARG N . 50747 1
402 . 1 . 1 69 69 ASP H H 1 8.296 0.001 . 1 . . 1171 . . 69 ASP H . 50747 1
403 . 1 . 1 69 69 ASP HA H 1 4.883 0.005 . 1 . . 1707 . . 69 ASP HA . 50747 1
404 . 1 . 1 69 69 ASP C C 13 173.723 0.005 . 1 . . 1500 . . 69 ASP C . 50747 1
405 . 1 . 1 69 69 ASP CA C 13 53.540 0.027 . 1 . . 1375 . . 69 ASP CA . 50747 1
406 . 1 . 1 69 69 ASP CB C 13 39.078 0.017 . 1 . . 1374 . . 69 ASP CB . 50747 1
407 . 1 . 1 69 69 ASP N N 15 125.068 0.029 . 1 . . 1172 . . 69 ASP N . 50747 1
408 . 1 . 1 70 70 VAL H H 1 7.294 0.002 . 1 . . 1107 . . 70 VAL H . 50747 1
409 . 1 . 1 70 70 VAL HA H 1 4.812 0.007 . 1 . . 1708 . . 70 VAL HA . 50747 1
410 . 1 . 1 70 70 VAL C C 13 174.301 0.006 . 1 . . 1501 . . 70 VAL C . 50747 1
411 . 1 . 1 70 70 VAL CA C 13 60.282 0.042 . 1 . . 1377 . . 70 VAL CA . 50747 1
412 . 1 . 1 70 70 VAL CB C 13 35.320 0.025 . 1 . . 1376 . . 70 VAL CB . 50747 1
413 . 1 . 1 70 70 VAL N N 15 119.933 0.029 . 1 . . 1108 . . 70 VAL N . 50747 1
414 . 1 . 1 71 71 ASN H H 1 9.134 0.003 . 1 . . 1159 . . 71 ASN H . 50747 1
415 . 1 . 1 71 71 ASN HA H 1 5.076 . . 1 . . 1709 . . 71 ASN HA . 50747 1
416 . 1 . 1 71 71 ASN HD21 H 1 7.176 0.002 . 1 . . 1109 . . 71 ASN HD21 . 50747 1
417 . 1 . 1 71 71 ASN HD22 H 1 7.450 0.002 . 1 . . 1116 . . 71 ASN HD22 . 50747 1
418 . 1 . 1 71 71 ASN C C 13 173.186 0.003 . 1 . . 1519 . . 71 ASN C . 50747 1
419 . 1 . 1 71 71 ASN CA C 13 52.911 0.004 . 1 . . 1423 . . 71 ASN CA . 50747 1
420 . 1 . 1 71 71 ASN CB C 13 43.012 0.005 . 1 . . 1422 . . 71 ASN CB . 50747 1
421 . 1 . 1 71 71 ASN N N 15 122.431 0.034 . 1 . . 1160 . . 71 ASN N . 50747 1
422 . 1 . 1 71 71 ASN ND2 N 15 114.854 0.04 . 1 . . 1110 . . 71 ASN ND2 . 50747 1
423 . 1 . 1 72 72 ALA H H 1 8.936 0.003 . 1 . . 1153 . . 72 ALA H . 50747 1
424 . 1 . 1 72 72 ALA HA H 1 4.872 . . 1 . . 1710 . . 72 ALA HA . 50747 1
425 . 1 . 1 72 72 ALA C C 13 175.810 0.007 . 1 . . 1520 . . 72 ALA C . 50747 1
426 . 1 . 1 72 72 ALA CA C 13 51.309 0.032 . 1 . . 1418 . . 72 ALA CA . 50747 1
427 . 1 . 1 72 72 ALA CB C 13 19.466 0.029 . 1 . . 1419 . . 72 ALA CB . 50747 1
428 . 1 . 1 72 72 ALA N N 15 125.171 0.074 . 1 . . 1154 . . 72 ALA N . 50747 1
429 . 1 . 1 73 73 LYS H H 1 8.096 0.002 . 1 . . 1212 . . 73 LYS H . 50747 1
430 . 1 . 1 73 73 LYS HA H 1 4.675 0.006 . 1 . . 1711 . . 73 LYS HA . 50747 1
431 . 1 . 1 73 73 LYS C C 13 175.148 0.004 . 1 . . 1516 . . 73 LYS C . 50747 1
432 . 1 . 1 73 73 LYS CA C 13 54.234 0.019 . 1 . . 1416 . . 73 LYS CA . 50747 1
433 . 1 . 1 73 73 LYS CB C 13 34.172 0.02 . 1 . . 1415 . . 73 LYS CB . 50747 1
434 . 1 . 1 73 73 LYS N N 15 121.741 0.043 . 1 . . 1213 . . 73 LYS N . 50747 1
435 . 1 . 1 74 74 PHE H H 1 9.096 0.002 . 1 . . 1149 . . 74 PHE H . 50747 1
436 . 1 . 1 74 74 PHE HA H 1 5.318 0.005 . 1 . . 1712 . . 74 PHE HA . 50747 1
437 . 1 . 1 74 74 PHE C C 13 176.500 0.003 . 1 . . 1517 . . 74 PHE C . 50747 1
438 . 1 . 1 74 74 PHE CA C 13 56.828 0.051 . 1 . . 1460 . . 74 PHE CA . 50747 1
439 . 1 . 1 74 74 PHE CB C 13 42.644 0.024 . 1 . . 1417 . . 74 PHE CB . 50747 1
440 . 1 . 1 74 74 PHE N N 15 124.465 0.03 . 1 . . 1150 . . 74 PHE N . 50747 1
441 . 1 . 1 75 75 ILE H H 1 8.885 0.002 . 1 . . 1248 . . 75 ILE H . 50747 1
442 . 1 . 1 75 75 ILE HA H 1 4.282 . . 1 . . 1713 . . 75 ILE HA . 50747 1
443 . 1 . 1 75 75 ILE C C 13 176.988 . . 1 . . 1549 . . 75 ILE C . 50747 1
444 . 1 . 1 75 75 ILE CA C 13 60.921 . . 1 . . 1462 . . 75 ILE CA . 50747 1
445 . 1 . 1 75 75 ILE CB C 13 40.029 . . 1 . . 1461 . . 75 ILE CB . 50747 1
446 . 1 . 1 75 75 ILE N N 15 121.282 0.035 . 1 . . 1249 . . 75 ILE N . 50747 1
447 . 1 . 1 77 77 GLY H H 1 8.850 . . 1 . . 1282 . . 77 GLY H . 50747 1
448 . 1 . 1 77 77 GLY HA2 H 1 3.680 . . 2 . . 1715 . . 77 GLY HA2 . 50747 1
449 . 1 . 1 77 77 GLY HA3 H 1 4.239 . . 2 . . 1716 . . 77 GLY HA3 . 50747 1
450 . 1 . 1 77 77 GLY C C 13 173.652 . . 1 . . 1607 . . 77 GLY C . 50747 1
451 . 1 . 1 77 77 GLY CA C 13 45.527 0.045 . 1 . . 1605 . . 77 GLY CA . 50747 1
452 . 1 . 1 77 77 GLY N N 15 102.867 . . 1 . . 1283 . . 77 GLY N . 50747 1
453 . 1 . 1 78 78 GLN H H 1 7.953 0.002 . 1 . . 1112 . . 78 GLN H . 50747 1
454 . 1 . 1 78 78 GLN HA H 1 5.084 . . 1 . . 1714 . . 78 GLN HA . 50747 1
455 . 1 . 1 78 78 GLN HE21 H 1 7.547 0.001 . 1 . . 1097 . . 78 GLN HE21 . 50747 1
456 . 1 . 1 78 78 GLN HE22 H 1 6.883 0.001 . 1 . . 1218 . . 78 GLN HE22 . 50747 1
457 . 1 . 1 78 78 GLN C C 13 173.173 . . 1 . . 1606 . . 78 GLN C . 50747 1
458 . 1 . 1 78 78 GLN CA C 13 51.858 0.021 . 1 . . 1604 . . 78 GLN CA . 50747 1
459 . 1 . 1 78 78 GLN CB C 13 30.445 0.009 . 1 . . 1603 . . 78 GLN CB . 50747 1
460 . 1 . 1 78 78 GLN N N 15 120.297 0.033 . 1 . . 1113 . . 78 GLN N . 50747 1
461 . 1 . 1 78 78 GLN NE2 N 15 112.073 0.057 . 1 . . 1098 . . 78 GLN NE2 . 50747 1
462 . 1 . 1 79 79 PRO HA H 1 4.240 . . 1 . . 1717 . . 79 PRO HA . 50747 1
463 . 1 . 1 79 79 PRO C C 13 177.083 . . 1 . . 1598 . . 79 PRO C . 50747 1
464 . 1 . 1 79 79 PRO CA C 13 62.017 0.046 . 1 . . 1596 . . 79 PRO CA . 50747 1
465 . 1 . 1 79 79 PRO CB C 13 30.775 . . 1 . . 1597 . . 79 PRO CB . 50747 1
466 . 1 . 1 80 80 VAL H H 1 8.641 0.002 . 1 . . 1229 . . 80 VAL H . 50747 1
467 . 1 . 1 80 80 VAL HA H 1 4.636 0.0 . 1 . . 1718 . . 80 VAL HA . 50747 1
468 . 1 . 1 80 80 VAL C C 13 175.800 . . 1 . . 1563 . . 80 VAL C . 50747 1
469 . 1 . 1 80 80 VAL CA C 13 60.551 0.041 . 1 . . 1594 . . 80 VAL CA . 50747 1
470 . 1 . 1 80 80 VAL CB C 13 34.062 . . 1 . . 1595 . . 80 VAL CB . 50747 1
471 . 1 . 1 80 80 VAL N N 15 112.851 0.034 . 1 . . 1230 . . 80 VAL N . 50747 1
472 . 1 . 1 81 81 ALA H H 1 7.687 0.001 . 1 . . 1067 . . 81 ALA H . 50747 1
473 . 1 . 1 81 81 ALA HA H 1 4.885 0.0 . 1 . . 1719 . . 81 ALA HA . 50747 1
474 . 1 . 1 81 81 ALA C C 13 175.636 0.014 . 1 . . 1543 . . 81 ALA C . 50747 1
475 . 1 . 1 81 81 ALA CA C 13 51.846 0.032 . 1 . . 1366 . . 81 ALA CA . 50747 1
476 . 1 . 1 81 81 ALA CB C 13 23.130 0.03 . 1 . . 1367 . . 81 ALA CB . 50747 1
477 . 1 . 1 81 81 ALA N N 15 121.004 0.035 . 1 . . 1068 . . 81 ALA N . 50747 1
478 . 1 . 1 82 82 ILE H H 1 8.154 0.002 . 1 . . 1214 . . 82 ILE H . 50747 1
479 . 1 . 1 82 82 ILE HA H 1 4.626 0.004 . 1 . . 1720 . . 82 ILE HA . 50747 1
480 . 1 . 1 82 82 ILE C C 13 173.874 0.001 . 1 . . 1507 . . 82 ILE C . 50747 1
481 . 1 . 1 82 82 ILE CA C 13 58.822 0.065 . 1 . . 1365 . . 82 ILE CA . 50747 1
482 . 1 . 1 82 82 ILE CB C 13 40.658 0.029 . 1 . . 1364 . . 82 ILE CB . 50747 1
483 . 1 . 1 82 82 ILE N N 15 117.819 0.032 . 1 . . 1215 . . 82 ILE N . 50747 1
484 . 1 . 1 83 83 GLU H H 1 8.872 0.003 . 1 . . 1131 . . 83 GLU H . 50747 1
485 . 1 . 1 83 83 GLU HA H 1 5.528 0.005 . 1 . . 1721 . . 83 GLU HA . 50747 1
486 . 1 . 1 83 83 GLU C C 13 174.634 0.003 . 1 . . 1508 . . 83 GLU C . 50747 1
487 . 1 . 1 83 83 GLU CA C 13 54.375 0.022 . 1 . . 1363 . . 83 GLU CA . 50747 1
488 . 1 . 1 83 83 GLU CB C 13 30.981 5.417 . 1 . . 1362 . . 83 GLU CB . 50747 1
489 . 1 . 1 83 83 GLU N N 15 125.865 0.066 . 1 . . 1132 . . 83 GLU N . 50747 1
490 . 1 . 1 84 84 ALA H H 1 8.949 0.002 . 1 . . 1225 . . 84 ALA H . 50747 1
491 . 1 . 1 84 84 ALA HA H 1 5.667 0.003 . 1 . . 1651 . . 84 ALA HA . 50747 1
492 . 1 . 1 84 84 ALA C C 13 176.441 0.01 . 1 . . 1535 . . 84 ALA C . 50747 1
493 . 1 . 1 84 84 ALA CA C 13 50.628 0.047 . 1 . . 1360 . . 84 ALA CA . 50747 1
494 . 1 . 1 84 84 ALA CB C 13 24.745 0.018 . 1 . . 1361 . . 84 ALA CB . 50747 1
495 . 1 . 1 84 84 ALA N N 15 124.474 0.057 . 1 . . 1226 . . 84 ALA N . 50747 1
496 . 1 . 1 85 85 THR H H 1 8.832 0.003 . 1 . . 1191 . . 85 THR H . 50747 1
497 . 1 . 1 85 85 THR HA H 1 5.669 0.002 . 1 . . 1722 . . 85 THR HA . 50747 1
498 . 1 . 1 85 85 THR C C 13 173.301 0.004 . 1 . . 1562 . . 85 THR C . 50747 1
499 . 1 . 1 85 85 THR CA C 13 61.485 0.072 . 1 . . 1359 . . 85 THR CA . 50747 1
500 . 1 . 1 85 85 THR CB C 13 71.599 0.041 . 1 . . 1358 . . 85 THR CB . 50747 1
501 . 1 . 1 85 85 THR N N 15 117.524 0.048 . 1 . . 1192 . . 85 THR N . 50747 1
502 . 1 . 1 86 86 TYR H H 1 9.849 0.003 . 1 . . 1161 . . 86 TYR H . 50747 1
503 . 1 . 1 86 86 TYR HA H 1 5.279 0.003 . 1 . . 1723 . . 86 TYR HA . 50747 1
504 . 1 . 1 86 86 TYR C C 13 173.311 0.002 . 1 . . 1523 . . 86 TYR C . 50747 1
505 . 1 . 1 86 86 TYR CA C 13 55.293 0.018 . 1 . . 1357 . . 86 TYR CA . 50747 1
506 . 1 . 1 86 86 TYR CB C 13 41.414 0.047 . 1 . . 1356 . . 86 TYR CB . 50747 1
507 . 1 . 1 86 86 TYR N N 15 127.657 0.029 . 1 . . 1162 . . 86 TYR N . 50747 1
508 . 1 . 1 87 87 THR H H 1 8.436 0.002 . 1 . . 1197 . . 87 THR H . 50747 1
509 . 1 . 1 87 87 THR HA H 1 4.356 0.006 . 1 . . 1724 . . 87 THR HA . 50747 1
510 . 1 . 1 87 87 THR C C 13 172.018 0.007 . 1 . . 1493 . . 87 THR C . 50747 1
511 . 1 . 1 87 87 THR CA C 13 63.372 0.057 . 1 . . 1353 . . 87 THR CA . 50747 1
512 . 1 . 1 87 87 THR CB C 13 69.391 0.083 . 1 . . 1352 . . 87 THR CB . 50747 1
513 . 1 . 1 87 87 THR N N 15 127.329 0.032 . 1 . . 1198 . . 87 THR N . 50747 1
514 . 1 . 1 88 88 MET H H 1 8.552 0.002 . 1 . . 1095 . . 88 MET H . 50747 1
515 . 1 . 1 88 88 MET HA H 1 4.218 0.003 . 1 . . 1725 . . 88 MET HA . 50747 1
516 . 1 . 1 88 88 MET C C 13 175.916 0.005 . 1 . . 1494 . . 88 MET C . 50747 1
517 . 1 . 1 88 88 MET CA C 13 54.319 0.029 . 1 . . 1355 . . 88 MET CA . 50747 1
518 . 1 . 1 88 88 MET CB C 13 37.055 0.04 . 1 . . 1354 . . 88 MET CB . 50747 1
519 . 1 . 1 88 88 MET N N 15 125.471 0.019 . 1 . . 1096 . . 88 MET N . 50747 1
520 . 1 . 1 89 89 ARG H H 1 9.061 0.003 . 1 . . 1216 . . 89 ARG H . 50747 1
521 . 1 . 1 89 89 ARG HA H 1 4.417 0.003 . 1 . . 1726 . . 89 ARG HA . 50747 1
522 . 1 . 1 89 89 ARG C C 13 174.194 0.009 . 1 . . 1513 . . 89 ARG C . 50747 1
523 . 1 . 1 89 89 ARG CA C 13 56.232 0.038 . 1 . . 1411 . . 89 ARG CA . 50747 1
524 . 1 . 1 89 89 ARG CB C 13 30.701 0.041 . 1 . . 1410 . . 89 ARG CB . 50747 1
525 . 1 . 1 89 89 ARG N N 15 121.568 0.043 . 1 . . 1217 . . 89 ARG N . 50747 1
526 . 1 . 1 90 90 SER H H 1 7.488 0.001 . 1 . . 1141 . . 90 SER H . 50747 1
527 . 1 . 1 90 90 SER HA H 1 5.216 . . 1 . . 1727 . . 90 SER HA . 50747 1
528 . 1 . 1 90 90 SER C C 13 173.745 . . 1 . . 1514 . . 90 SER C . 50747 1
529 . 1 . 1 90 90 SER CA C 13 56.216 0.022 . 1 . . 1413 . . 90 SER CA . 50747 1
530 . 1 . 1 90 90 SER CB C 13 64.778 0.02 . 1 . . 1412 . . 90 SER CB . 50747 1
531 . 1 . 1 90 90 SER N N 15 111.871 0.017 . 1 . . 1142 . . 90 SER N . 50747 1
532 . 1 . 1 91 91 PRO HA H 1 4.305 . . 1 . . 1728 . . 91 PRO HA . 50747 1
533 . 1 . 1 91 91 PRO C C 13 177.882 . . 1 . . 1620 . . 91 PRO C . 50747 1
534 . 1 . 1 91 91 PRO CA C 13 65.128 0.016 . 1 . . 1618 . . 91 PRO CA . 50747 1
535 . 1 . 1 91 91 PRO CB C 13 32.068 0.028 . 1 . . 1617 . . 91 PRO CB . 50747 1
536 . 1 . 1 92 92 GLN H H 1 8.273 0.006 . 1 . . 1615 . . 92 GLN H . 50747 1
537 . 1 . 1 92 92 GLN HA H 1 4.214 . . 1 . . 1729 . . 92 GLN HA . 50747 1
538 . 1 . 1 92 92 GLN C C 13 179.793 0.01 . 1 . . 1619 . . 92 GLN C . 50747 1
539 . 1 . 1 92 92 GLN CA C 13 60.067 0.015 . 1 . . 1616 . . 92 GLN CA . 50747 1
540 . 1 . 1 92 92 GLN N N 15 115.954 0.069 . 1 . . 1614 . . 92 GLN N . 50747 1
541 . 1 . 1 93 93 GLU H H 1 7.892 0.005 . 1 . . 1145 . . 93 GLU H . 50747 1
542 . 1 . 1 93 93 GLU HA H 1 4.147 . . 1 . . 1730 . . 93 GLU HA . 50747 1
543 . 1 . 1 93 93 GLU C C 13 180.054 0.002 . 1 . . 1527 . . 93 GLU C . 50747 1
544 . 1 . 1 93 93 GLU CA C 13 59.260 0.012 . 1 . . 1400 . . 93 GLU CA . 50747 1
545 . 1 . 1 93 93 GLU CB C 13 30.509 0.051 . 1 . . 1407 . . 93 GLU CB . 50747 1
546 . 1 . 1 93 93 GLU N N 15 119.862 0.068 . 1 . . 1146 . . 93 GLU N . 50747 1
547 . 1 . 1 94 94 TRP H H 1 7.900 0.003 . 1 . . 1169 . . 94 TRP H . 50747 1
548 . 1 . 1 94 94 TRP HA H 1 4.902 0.004 . 1 . . 1731 . . 94 TRP HA . 50747 1
549 . 1 . 1 94 94 TRP HE1 H 1 9.884 0.007 . 1 . . 1231 . . 94 TRP HE1 . 50747 1
550 . 1 . 1 94 94 TRP C C 13 176.647 0.01 . 1 . . 1528 . . 94 TRP C . 50747 1
551 . 1 . 1 94 94 TRP CA C 13 60.631 0.053 . 1 . . 1406 . . 94 TRP CA . 50747 1
552 . 1 . 1 94 94 TRP CB C 13 28.023 0.035 . 1 . . 1405 . . 94 TRP CB . 50747 1
553 . 1 . 1 94 94 TRP N N 15 122.357 0.069 . 1 . . 1170 . . 94 TRP N . 50747 1
554 . 1 . 1 94 94 TRP NE1 N 15 130.644 0.035 . 1 . . 1232 . . 94 TRP NE1 . 50747 1
555 . 1 . 1 95 95 ASP H H 1 8.846 0.002 . 1 . . 1193 . . 95 ASP H . 50747 1
556 . 1 . 1 95 95 ASP HA H 1 4.242 . . 1 . . 1732 . . 95 ASP HA . 50747 1
557 . 1 . 1 95 95 ASP C C 13 179.470 0.002 . 1 . . 1521 . . 95 ASP C . 50747 1
558 . 1 . 1 95 95 ASP CA C 13 57.633 0.055 . 1 . . 1403 . . 95 ASP CA . 50747 1
559 . 1 . 1 95 95 ASP CB C 13 39.823 0.021 . 1 . . 1404 . . 95 ASP CB . 50747 1
560 . 1 . 1 95 95 ASP N N 15 118.422 0.058 . 1 . . 1194 . . 95 ASP N . 50747 1
561 . 1 . 1 96 96 ARG H H 1 7.886 0.001 . 1 . . 1157 . . 96 ARG H . 50747 1
562 . 1 . 1 96 96 ARG HA H 1 3.904 0.01 . 1 . . 1733 . . 96 ARG HA . 50747 1
563 . 1 . 1 96 96 ARG HE H 1 7.110 0.007 . 1 . . 1155 . . 96 ARG HE . 50747 1
564 . 1 . 1 96 96 ARG C C 13 178.831 0.009 . 1 . . 1522 . . 96 ARG C . 50747 1
565 . 1 . 1 96 96 ARG CA C 13 59.206 0.02 . 1 . . 1402 . . 96 ARG CA . 50747 1
566 . 1 . 1 96 96 ARG CB C 13 29.202 0.037 . 1 . . 1399 . . 96 ARG CB . 50747 1
567 . 1 . 1 96 96 ARG N N 15 119.560 0.053 . 1 . . 1158 . . 96 ARG N . 50747 1
568 . 1 . 1 96 96 ARG NE N 15 84.944 0.458 . 1 . . 1156 . . 96 ARG NE . 50747 1
569 . 1 . 1 97 97 PHE H H 1 7.927 0.003 . 1 . . 1137 . . 97 PHE H . 50747 1
570 . 1 . 1 97 97 PHE HA H 1 4.105 0.007 . 1 . . 1734 . . 97 PHE HA . 50747 1
571 . 1 . 1 97 97 PHE C C 13 176.353 0.007 . 1 . . 1547 . . 97 PHE C . 50747 1
572 . 1 . 1 97 97 PHE CA C 13 61.477 0.053 . 1 . . 1401 . . 97 PHE CA . 50747 1
573 . 1 . 1 97 97 PHE CB C 13 40.689 0.043 . 1 . . 1442 . . 97 PHE CB . 50747 1
574 . 1 . 1 97 97 PHE N N 15 122.791 0.06 . 1 . . 1138 . . 97 PHE N . 50747 1
575 . 1 . 1 98 98 ILE H H 1 8.457 0.002 . 1 . . 1240 . . 98 ILE H . 50747 1
576 . 1 . 1 98 98 ILE HA H 1 3.203 0.005 . 1 . . 1735 . . 98 ILE HA . 50747 1
577 . 1 . 1 98 98 ILE C C 13 177.938 0.002 . 1 . . 1548 . . 98 ILE C . 50747 1
578 . 1 . 1 98 98 ILE CA C 13 61.487 0.048 . 1 . . 1441 . . 98 ILE CA . 50747 1
579 . 1 . 1 98 98 ILE CB C 13 34.468 0.054 . 1 . . 1440 . . 98 ILE CB . 50747 1
580 . 1 . 1 98 98 ILE N N 15 121.341 0.033 . 1 . . 1241 . . 98 ILE N . 50747 1
581 . 1 . 1 99 99 ARG H H 1 7.593 0.002 . 1 . . 1246 . . 99 ARG H . 50747 1
582 . 1 . 1 99 99 ARG HA H 1 4.085 0.01 . 1 . . 1736 . . 99 ARG HA . 50747 1
583 . 1 . 1 99 99 ARG HE H 1 9.885 0.002 . 1 . . 1177 . . 99 ARG HE . 50747 1
584 . 1 . 1 99 99 ARG C C 13 169.457 0.004 . 1 . . 1536 . . 99 ARG C . 50747 1
585 . 1 . 1 99 99 ARG CA C 13 61.221 0.051 . 1 . . 1437 . . 99 ARG CA . 50747 1
586 . 1 . 1 99 99 ARG CB C 13 30.868 0.059 . 1 . . 1436 . . 99 ARG CB . 50747 1
587 . 1 . 1 99 99 ARG N N 15 116.891 0.045 . 1 . . 1247 . . 99 ARG N . 50747 1
588 . 1 . 1 99 99 ARG NE N 15 84.701 0.354 . 1 . . 1178 . . 99 ARG NE . 50747 1
589 . 1 . 1 100 100 PHE H H 1 7.283 0.003 . 1 . . 1200 . . 100 PHE H . 50747 1
590 . 1 . 1 100 100 PHE HA H 1 4.469 0.003 . 1 . . 1737 . . 100 PHE HA . 50747 1
591 . 1 . 1 100 100 PHE C C 13 176.516 . . 1 . . 1537 . . 100 PHE C . 50747 1
592 . 1 . 1 100 100 PHE CA C 13 61.690 0.054 . 1 . . 1439 . . 100 PHE CA . 50747 1
593 . 1 . 1 100 100 PHE CB C 13 37.806 0.054 . 1 . . 1438 . . 100 PHE CB . 50747 1
594 . 1 . 1 100 100 PHE N N 15 118.317 0.053 . 1 . . 1201 . . 100 PHE N . 50747 1
595 . 1 . 1 101 101 MET H H 1 8.677 0.002 . 1 . . 1123 . . 101 MET H . 50747 1
596 . 1 . 1 101 101 MET HA H 1 3.709 0.008 . 1 . . 1739 . . 101 MET HA . 50747 1
597 . 1 . 1 101 101 MET C C 13 179.182 0.008 . 1 . . 1497 . . 101 MET C . 50747 1
598 . 1 . 1 101 101 MET CA C 13 55.042 0.031 . 1 . . 1291 . . 101 MET CA . 50747 1
599 . 1 . 1 101 101 MET CB C 13 29.755 0.061 . 1 . . 1292 . . 101 MET CB . 50747 1
600 . 1 . 1 101 101 MET N N 15 120.156 0.028 . 1 . . 1124 . . 101 MET N . 50747 1
601 . 1 . 1 102 102 ASP H H 1 8.858 0.001 . 1 . . 1103 . . 102 ASP H . 50747 1
602 . 1 . 1 102 102 ASP HA H 1 4.501 0.005 . 1 . . 1738 . . 102 ASP HA . 50747 1
603 . 1 . 1 102 102 ASP C C 13 169.864 0.007 . 1 . . 1498 . . 102 ASP C . 50747 1
604 . 1 . 1 102 102 ASP CA C 13 57.556 0.06 . 1 . . 1289 . . 102 ASP CA . 50747 1
605 . 1 . 1 102 102 ASP CB C 13 39.778 0.017 . 1 . . 1290 . . 102 ASP CB . 50747 1
606 . 1 . 1 102 102 ASP N N 15 120.323 0.049 . 1 . . 1104 . . 102 ASP N . 50747 1
607 . 1 . 1 103 103 ARG H H 1 7.339 0.001 . 1 . . 1210 . . 103 ARG H . 50747 1
608 . 1 . 1 103 103 ARG HA H 1 4.037 0.003 . 1 . . 1740 . . 103 ARG HA . 50747 1
609 . 1 . 1 103 103 ARG C C 13 179.155 0.012 . 1 . . 1499 . . 103 ARG C . 50747 1
610 . 1 . 1 103 103 ARG CA C 13 59.014 0.044 . 1 . . 1288 . . 103 ARG CA . 50747 1
611 . 1 . 1 103 103 ARG CB C 13 30.943 0.084 . 1 . . 1287 . . 103 ARG CB . 50747 1
612 . 1 . 1 103 103 ARG N N 15 121.679 0.04 . 1 . . 1211 . . 103 ARG N . 50747 1
613 . 1 . 1 104 104 TYR H H 1 9.100 0.002 . 1 . . 1105 . . 104 TYR H . 50747 1
614 . 1 . 1 104 104 TYR HA H 1 3.603 0.004 . 1 . . 1741 . . 104 TYR HA . 50747 1
615 . 1 . 1 104 104 TYR C C 13 179.251 0.013 . 1 . . 1479 . . 104 TYR C . 50747 1
616 . 1 . 1 104 104 TYR CA C 13 62.304 0.025 . 1 . . 1285 . . 104 TYR CA . 50747 1
617 . 1 . 1 104 104 TYR CB C 13 38.646 0.087 . 1 . . 1284 . . 104 TYR CB . 50747 1
618 . 1 . 1 104 104 TYR N N 15 123.385 0.05 . 1 . . 1106 . . 104 TYR N . 50747 1
619 . 1 . 1 105 105 ALA H H 1 9.846 0.002 . 1 . . 1061 . . 105 ALA H . 50747 1
620 . 1 . 1 105 105 ALA HA H 1 3.854 0.005 . 1 . . 1742 . . 105 ALA HA . 50747 1
621 . 1 . 1 105 105 ALA C C 13 179.456 0.01 . 1 . . 1480 . . 105 ALA C . 50747 1
622 . 1 . 1 105 105 ALA CA C 13 55.985 0.052 . 1 . . 1286 . . 105 ALA CA . 50747 1
623 . 1 . 1 105 105 ALA CB C 13 18.873 0.046 . 1 . . 1396 . . 105 ALA CB . 50747 1
624 . 1 . 1 105 105 ALA N N 15 123.564 0.04 . 1 . . 1062 . . 105 ALA N . 50747 1
625 . 1 . 1 106 106 ALA H H 1 7.424 0.002 . 1 . . 1238 . . 106 ALA H . 50747 1
626 . 1 . 1 106 106 ALA HA H 1 4.313 0.005 . 1 . . 1743 . . 106 ALA HA . 50747 1
627 . 1 . 1 106 106 ALA C C 13 179.471 . . 1 . . 1569 . . 106 ALA C . 50747 1
628 . 1 . 1 106 106 ALA CA C 13 54.580 0.017 . 1 . . 1394 . . 106 ALA CA . 50747 1
629 . 1 . 1 106 106 ALA CB C 13 18.431 0.059 . 1 . . 1395 . . 106 ALA CB . 50747 1
630 . 1 . 1 106 106 ALA N N 15 117.081 0.032 . 1 . . 1239 . . 106 ALA N . 50747 1
631 . 1 . 1 107 107 SER H H 1 7.567 0.002 . 1 . . 1264 . . 107 SER H . 50747 1
632 . 1 . 1 107 107 SER HA H 1 4.526 0.003 . 1 . . 1744 . . 107 SER HA . 50747 1
633 . 1 . 1 107 107 SER C C 13 175.396 0.021 . 1 . . 1554 . . 107 SER C . 50747 1
634 . 1 . 1 107 107 SER CA C 13 58.261 0.066 . 1 . . 1392 . . 107 SER CA . 50747 1
635 . 1 . 1 107 107 SER CB C 13 64.525 0.052 . 1 . . 1393 . . 107 SER CB . 50747 1
636 . 1 . 1 107 107 SER N N 15 108.692 0.021 . 1 . . 1265 . . 107 SER N . 50747 1
637 . 1 . 1 108 108 HIS H H 1 7.651 0.003 . 1 . . 1268 . . 108 HIS H . 50747 1
638 . 1 . 1 108 108 HIS HA H 1 4.760 0.02 . 1 . . 1745 . . 108 HIS HA . 50747 1
639 . 1 . 1 108 108 HIS C C 13 174.139 0.012 . 1 . . 1555 . . 108 HIS C . 50747 1
640 . 1 . 1 108 108 HIS CA C 13 56.399 0.026 . 1 . . 1391 . . 108 HIS CA . 50747 1
641 . 1 . 1 108 108 HIS CB C 13 28.663 0.07 . 1 . . 1390 . . 108 HIS CB . 50747 1
642 . 1 . 1 108 108 HIS N N 15 116.305 0.024 . 1 . . 1269 . . 108 HIS N . 50747 1
643 . 1 . 1 109 109 GLY H H 1 7.949 0.008 . 1 . . 1276 . . 109 GLY H . 50747 1
644 . 1 . 1 109 109 GLY HA2 H 1 3.992 0.007 . 1 . . 1746 . . 109 GLY HA2 . 50747 1
645 . 1 . 1 109 109 GLY HA3 H 1 3.992 0.007 . 1 . . 1747 . . 109 GLY HA3 . 50747 1
646 . 1 . 1 109 109 GLY C C 13 174.639 0.007 . 1 . . 1551 . . 109 GLY C . 50747 1
647 . 1 . 1 109 109 GLY CA C 13 47.594 0.052 . 1 . . 1389 . . 109 GLY CA . 50747 1
648 . 1 . 1 109 109 GLY N N 15 108.653 0.03 . 1 . . 1277 . . 109 GLY N . 50747 1
649 . 1 . 1 110 110 LEU H H 1 8.130 0.003 . 1 . . 1256 . . 110 LEU H . 50747 1
650 . 1 . 1 110 110 LEU HA H 1 5.211 0.01 . 1 . . 1643 . . 110 LEU HA . 50747 1
651 . 1 . 1 110 110 LEU C C 13 176.393 0.003 . 1 . . 1505 . . 110 LEU C . 50747 1
652 . 1 . 1 110 110 LEU CA C 13 53.695 0.062 . 1 . . 1386 . . 110 LEU CA . 50747 1
653 . 1 . 1 110 110 LEU CB C 13 45.823 0.082 . 1 . . 1387 . . 110 LEU CB . 50747 1
654 . 1 . 1 110 110 LEU N N 15 116.458 0.058 . 1 . . 1257 . . 110 LEU N . 50747 1
655 . 1 . 1 111 111 GLY H H 1 9.011 0.003 . 1 . . 1125 . . 111 GLY H . 50747 1
656 . 1 . 1 111 111 GLY HA2 H 1 4.591 0.003 . 2 . . 1644 . . 111 GLY HA2 . 50747 1
657 . 1 . 1 111 111 GLY HA3 H 1 3.686 0.003 . 2 . . 1648 . . 111 GLY HA3 . 50747 1
658 . 1 . 1 111 111 GLY C C 13 172.190 . . 1 . . 1579 . . 111 GLY C . 50747 1
659 . 1 . 1 111 111 GLY CA C 13 44.136 0.044 . 1 . . 1578 . . 111 GLY CA . 50747 1
660 . 1 . 1 111 111 GLY N N 15 108.539 0.043 . 1 . . 1126 . . 111 GLY N . 50747 1
661 . 1 . 1 112 112 PHE H H 1 8.683 0.02 . 1 . . 1127 . . 112 PHE H . 50747 1
662 . 1 . 1 112 112 PHE HA H 1 4.553 0.02 . 1 . . 1645 . . 112 PHE HA . 50747 1
663 . 1 . 1 112 112 PHE C C 13 174.506 0.006 . 1 . . 1524 . . 112 PHE C . 50747 1
664 . 1 . 1 112 112 PHE CA C 13 56.702 0.058 . 1 . . 1424 . . 112 PHE CA . 50747 1
665 . 1 . 1 112 112 PHE CB C 13 40.788 0.049 . 1 . . 1425 . . 112 PHE CB . 50747 1
666 . 1 . 1 112 112 PHE N N 15 122.784 0.024 . 1 . . 1128 . . 112 PHE N . 50747 1
667 . 1 . 1 113 113 GLN H H 1 8.011 0.004 . 1 . . 1163 . . 113 GLN H . 50747 1
668 . 1 . 1 113 113 GLN HA H 1 3.991 0.007 . 1 . . 1646 . . 113 GLN HA . 50747 1
669 . 1 . 1 113 113 GLN C C 13 172.898 0.005 . 1 . . 1525 . . 113 GLN C . 50747 1
670 . 1 . 1 113 113 GLN CA C 13 53.546 0.029 . 1 . . 1427 . . 113 GLN CA . 50747 1
671 . 1 . 1 113 113 GLN CB C 13 30.894 0.062 . 1 . . 1426 . . 113 GLN CB . 50747 1
672 . 1 . 1 113 113 GLN N N 15 128.240 0.024 . 1 . . 1164 . . 113 GLN N . 50747 1
673 . 1 . 1 114 114 LYS H H 1 8.070 0.004 . 1 . . 1266 . . 114 LYS H . 50747 1
674 . 1 . 1 114 114 LYS HA H 1 3.756 0.004 . 1 . . 1647 . . 114 LYS HA . 50747 1
675 . 1 . 1 114 114 LYS C C 13 176.750 0.004 . 1 . . 1545 . . 114 LYS C . 50747 1
676 . 1 . 1 114 114 LYS CA C 13 55.438 0.067 . 1 . . 1456 . . 114 LYS CA . 50747 1
677 . 1 . 1 114 114 LYS CB C 13 32.910 0.044 . 1 . . 1457 . . 114 LYS CB . 50747 1
678 . 1 . 1 114 114 LYS N N 15 124.559 0.021 . 1 . . 1267 . . 114 LYS N . 50747 1
679 . 1 . 1 115 115 SER H H 1 7.851 0.002 . 1 . . 1223 . . 115 SER H . 50747 1
680 . 1 . 1 115 115 SER HA H 1 4.349 0.003 . 1 . . 1625 . . 115 SER HA . 50747 1
681 . 1 . 1 115 115 SER C C 13 174.698 . . 1 . . 1612 . . 115 SER C . 50747 1
682 . 1 . 1 115 115 SER CA C 13 59.310 0.031 . 1 . . 1459 . . 115 SER CA . 50747 1
683 . 1 . 1 115 115 SER CB C 13 63.228 0.031 . 1 . . 1458 . . 115 SER CB . 50747 1
684 . 1 . 1 115 115 SER N N 15 121.397 0.045 . 1 . . 1224 . . 115 SER N . 50747 1
685 . 1 . 1 116 116 GLU H H 1 8.697 0.005 . 1 . . 1574 . . 116 GLU H . 50747 1
686 . 1 . 1 116 116 GLU CA C 13 56.532 . . 1 . . 1611 . . 116 GLU CA . 50747 1
687 . 1 . 1 116 116 GLU N N 15 124.355 0.053 . 1 . . 1575 . . 116 GLU N . 50747 1
stop_
save_